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CHEBI:203163 - (7beta)-7,29-dihydroxysoyasapogenol B
| Formula | C30H50O5 |
| Net Charge | 0 |
| Average Mass | 490.725 |
| Monoisotopic Mass | 490.36582 |
| SMILES | C[C@@]1(CO)C[C@@H](O)[C@]2(C)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@](C)(CO)[C@@H]5C[C@H](O)[C@]43C)[C@@H]2C1 |
| InChI | InChI=1S/C30H50O5/c1-25(16-31)14-19-18-7-8-20-27(3)10-9-22(33)28(4,17-32)21(27)13-23(34)30(20,6)29(18,5)12-11-26(19,2)24(35)15-25/h7,19-24,31-35H,8-17H2,1-6H3/t19-,20+,21+,22-,23-,24+,25-,26+,27+,28+,29+,30-/m0/s1 |
| InChIKey | HFGFIRVGLTVCJV-JSSCJGPGSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Neopestalotiopsis clavispora (ncbitaxon:289240) | - | DOI (10.1002/hlca.201000404) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| (7beta)-7,29-dihydroxysoyasapogenol B (CHEBI:203163) is a triterpenoid (CHEBI:36615) |
| IUPAC Name |
|---|
| (3S,4S,4aR,6S,6aR,6bR,8aR,9R,11S,12aS,14aR,14bR)-4,11-bis(hydroxymethyl)-4,6a,6b,8a,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicene-3,6,9-triol |
| Manual Xrefs | Databases |
|---|---|
| 28185127 | ChemSpider |